N-[1-[(3,5-diethoxy-4-fluoranyl-phenyl)methyl]piperidin-4-yl]-7-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-amine

Systemtic Name: N-[1-[(3,5-diethoxy-4-fluoranyl-phenyl)methyl]piperidin-4-yl]-7-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-amine Openeye Name: N-[1-[(3,5-diethoxy-4-fluoro-phenyl)methyl]-4-piperidyl]-7-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-amine CAS Name: N-[1-[(3,5-diethoxy-4-fluorophenyl)methyl]-4-piperidinyl]-7-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-2-amine IUPAC Name: N-[1-[(3,5-diethoxy-4-fluorophenyl)methyl]piperidin-4-yl]-7-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-amine Traditional Name: [1-(3,5-diethoxy-4-fluoro-benzyl)-4-piperidyl]-(7-pyrrolidinosulfonyl-1,3-benzoxazol-2-yl)amine Formula: C27H35FN4O5S MolecularWeight: 546.654003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1F)OCC)CN2CCC(CC2)NC3=NC4=C(O3)C(=CC=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CCOC1=CC(=CC(=C1F)OCC)CN2CCC(CC2)NC3=NC4=C(O3)C(=CC=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C27H35FN4O5S/c1-3-35-22-16-19(17-23(25(22)28)36-4-2)18-31-14-10-20(11-15-31)29-27-30-21-8-7-9-24(26(21)37-27)38(33,34)32-12-5-6-13-32/h7-9,16-17,20H,3-6,10-15,18H2,1-2H3,(H,29,30)